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Ethoxycarbonyl Isothiocyanate

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Ethoxycarbonyl Isothiocyanate Basic information

Product Name:
Ethoxycarbonyl Isothiocyanate
Synonyms:
  • Ethyl isothiocyanatidocarbonate
  • ETHYL ISOTHIOCYANATOFORMATE,98%
  • (Ethoxyoxomethyl) isothiocyanate
  • Ethoxy(oxo)methyl isothiocyanate
  • Isothiocyanatoformic acid ethyl
  • CARBETHOXYISOTHIOCYANATE
  • CARBON(ISOTHIOCYANATIDIC)ACID, ETHYL ESTER
  • ISOTHIOCYANATOFORMIC ACID ETHYL ESTER
CAS:
16182-04-0
MF:
C4H5NO2S
MW:
131.15
EINECS:
240-318-9
Product Categories:
  • Miscellaneous Reagents
Mol File:
16182-04-0.mol
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Ethoxycarbonyl Isothiocyanate Chemical Properties

Boiling point:
56 °C18 mm Hg(lit.)
Density 
1.112 g/mL at 25 °C(lit.)
refractive index 
n20/D 1.500(lit.)
Flash point:
123 °F
storage temp. 
2-8°C
solubility 
Soluble in chloroform and ether.
Specific Gravity
1.112
Sensitive 
Moisture Sensitive/Lachrymatory
BRN 
606091
InChIKey
BDTDECDAHYOJRO-UHFFFAOYSA-N
CAS DataBase Reference
16182-04-0(CAS DataBase Reference)
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Safety Information

Hazard Codes 
T,Xi
Risk Statements 
23-36/37/38-42
Safety Statements 
23-26-36/37/39-45
RIDADR 
UN 2929 6.1/PG 2
WGK Germany 
3
9-13-19-21
HazardClass 
3
PackingGroup 
III
HS Code 
29309090

MSDS

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Ethoxycarbonyl Isothiocyanate Usage And Synthesis

Chemical Properties

Light Yellow Oil

Uses

Versatile reagent for organic synthesis.
Ethoxycarbonyl isothiocyanate is used as a building block in the synthesis of various heterocycles. It is also used for the synthesis of 1,2,4-oxadiazolidine-3,5-dione. It is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff.

Application

Ethoxycarbonyl isothiocyanate reacts with 2-amino-tetrahydrobenzo[b]thiophene derivatives to yield tetrahydrobenzo[b]thiophen-2-thiourea derivatives.
Ethoxycarbonyl isothiocyanate has been used in the synthesis of:
pyrazolo[1,5-a][1,3,5]triazine derivatives, potential inhibitors of protein kinase CK2
fused thiophene derivatives, having antibacterial and antifungal activities
4-thiouracil derivatives
thiocarbamides from stannylarenes
1,3,5-triazin-2-one-4-thiones from 2-amino-2-oxazolines
N-acylthioureas from aminodeoxy sugars

Synthesis Reference(s)

Using Schiff base as a phase transfer catalyst, ethoxycarbonyl isothiocyanate was synthesized by reacting ethyl chloroformate with sodium thiocyanate. www.semanticscholar.org

Hazard

Lachrymator.

Ethoxycarbonyl Isothiocyanate Preparation Products And Raw materials

Preparation Products

Ethoxycarbonyl IsothiocyanateSupplier

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